Vitas-M small molecule compound
ethyl 4-{N-[2-chloro-5-(trifluoromethyl)phenyl]-N-(phenylsulfonyl)glycyl}piperazine-1-carboxylate
Catalog ID
STL070629
SMILES CCOC(=O)N1CCN(CC1)C(=O)CN(S(=O)(=O)c1ccccc1)c1cc(ccc1Cl)C(F)(F)F
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C22H23ClF3N3O5S MW 533.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23ClF3N3O5S/c1-2-34-21(31)28-12-10-27(11-13-28)20(30)15-29(35(32,33)17-6-4-3-5-7-17)19-14-16(22(24,25)26)8-9-18(19)23/h3-9,14H,2,10-13,15H2,1H3InChIKey
WHHBYNFEBLPXLC-UHFFFAOYSA-NSynonyms
CCOC(=O)N1CCN(CC1)C(=O)CN(C2=C(C=CC(=C2)C(F)(F)F)Cl)S(=O)(=O)C3=CC=CC=C3
ETHYL4(2(N(BENZENESULFONYL)2CHLORO5(TRIFLUOROMETHYL)ANILINO)ACETYL)PIPERAZINE1CARBOXYLATE
ethyl4(N(2chloro5(trifluoromethyl)phenyl)N(phenylsulfonyl)glycyl)piperazine1carboxylate
InChI=1SC22H23ClF3N3O5Sc123421(31)28121027(111328)20(30)1529(35(3233)176435717)191416(22(2425)26)8918(19)23h3914H2101315H21H3
MFCD03236207
ZINC000059845024
ZINC59845024
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